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	hartrees
Energy at 0K	-228.524381
Energy at 298.15K	-228.529202
Nuclear repulsion energy	120.181460

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3741	3588	70.48
2	A'	3222	3090	3.30
3	A'	3090	2964	1.70
4	A'	1791	1718	280.79
5	A'	1463	1403	13.49
6	A'	1403	1346	67.70
7	A'	1328	1274	23.23
8	A'	1204	1155	214.53
9	A'	995	954	64.24
10	A'	867	832	8.42
11	A'	577	553	37.00
12	A'	419	402	3.93
13	A"	3179	3049	2.52
14	A"	1469	1409	8.09
15	A"	1056	1013	4.39
16	A"	658	631	96.18
17	A"	551	529	18.47
18	A"	79	76	0.23

Atom	x (Å)	y (Å)	z (Å)
C1	1.084	-0.891	0.000
C2	0.000	0.155	0.000
O3	0.161	1.365	0.000
H4	2.064	-0.400	0.000
H5	0.977	-1.531	0.888
H6	0.977	-1.531	-0.888
O7	-1.242	-0.421	0.000
H8	-1.877	0.317	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.5067	2.4374	1.0955	1.1000	1.1000	2.3733	3.1982
C2	1.5067		1.2204	2.1373	2.1414	2.1414	1.3692	1.8839
O3	2.4374	1.2204		2.5955	3.1368	3.1368	2.2713	2.2916
H4	1.0955	2.1373	2.5955		1.8024	1.8024	3.3059	4.0056
H5	1.1000	2.1414	3.1368	1.8024		1.7764	2.6350	3.5139
H6	1.1000	2.1414	3.1368	1.8024	1.7764		2.6350	3.5139
O7	2.3733	1.3692	2.2713	3.3059	2.6350	2.6350		0.9737
H8	3.1982	1.8839	2.2916	4.0056	3.5139	3.5139	0.9737

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.382	C1	C2	O7	111.138
C2	C1	H4	109.428	C2	C1	H5	109.482
C2	C1	H6	109.482	C2	O7	H8	105.804
O3	C2	O7	122.480	H4	C1	H5	110.363
H4	C1	H6	110.363	H5	C1	H6	107.697

All results from a given calculation for CH₃COOH (Acetic acid)

using model chemistry: MP2/aug-cc-pVDZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3COOH (Acetic acid)

using model chemistry: MP2/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃COOH (Acetic acid)